Geometry & MOs

Info

ID:	280858
PubChem CID:	103851640
Reduced:	N3C16H23 (1)
Stoich.:	A3B16C23 (1)
Weight, g/mol:	276.231397
ΔH_f, kcal/mol:	28.41
Dipole, Da:	5.34
IP(EA), eV:	-8.69(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-(3-methylbut-2-enyl)piperidin-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(C)NCC2=C(N(N=C2)C)C)C

DOS

IR

Vibrations